C23H28ClNO6S
TL;DR: C23H28ClNO6S (CAS 1013772-71-8) is a chemical compound with molecular formula C23H28ClNO6S and molecular weight 481.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
Also Known As: (S)-2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-4-(methylthio)butanoate, (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate, C23H28ClNO6S
| Molecular Formula | C23H28ClNO6S |
|---|---|
| Molecular Weight | 481.13 g/mol |
| LogP | 4.877 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 481.1326 |
| Heavy Atoms | 32 |
| Complexity | 1074.8118 |
Chemical Identifiers
| CAS Number | 1013772-71-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)OC1=C(C=C2C3=C(CCCC3)C(=O)OC2=C1)Cl |
Product Overview
C23H28ClNO6S (CAS 1013772-71-8), with molecular formula C23H28ClNO6S and molecular weight 481.13 g/mol. IUPAC: (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate.
Chemical Property Profile of C23H28ClNO6S
Property Insights of C23H28ClNO6S
The XLogP value of 4.877 indicates that C23H28ClNO6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H28ClNO6S. Following Lipinski's Rule of Five, C23H28ClNO6S has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C23H28ClNO6S?
The CAS number of C23H28ClNO6S is 1013772-71-8.
What is the molecular formula of C23H28ClNO6S?
The molecular formula of C23H28ClNO6S is C23H28ClNO6S.
What is the molecular weight of C23H28ClNO6S?
The molecular weight of C23H28ClNO6S is 481.13 g/mol.
Where can I buy C23H28ClNO6S?
You can request a quote for C23H28ClNO6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H28ClNO6S?
Yes, KEHONG BIO provides custom synthesis services for C23H28ClNO6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.